ChemSpider 2D Image | 1-Methyl-7-(~2~H_1_)methyl(~2~H_2_)-7,9-dihydro-1H-purine-2,6,8(3H)-trione | C7H5D3N4O3

1-Methyl-7-(2H1)methyl(2H2)-7,9-dihydro-1H-purine-2,6,8(3H)-trione

  • Molecular FormulaC7H5D3N4O3
  • Average mass199.182 Da
  • Monoisotopic mass199.078476 Da
  • ChemSpider ID31046234

  • Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Purine-2,6,8(3H)-trione-3-d, 7,9-dihydro-9-d-1-methyl-7-(methyl-d)- [ACD/Index Name]
1-Methyl-7-(2H1)methyl(2H2)-7,9-dihydro-1H-purin-2,6,8(3H)-trion [German] [ACD/IUPAC Name]
1-Methyl-7-(2H1)methyl(2H2)-7,9-dihydro-1H-purine-2,6,8(3H)-trione [ACD/IUPAC Name]
1-Méthyl-7-(2H1)méthyl(2H2)-7,9-dihydro-1H-purine-2,6,8(3H)-trione [French] [ACD/IUPAC Name]
1,7-Dimethyluric Acid-d3
1189713-08-3 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.676
Molar Refractivity: 45.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.59
ACD/LogD (pH 5.5): -0.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.22
ACD/LogD (pH 7.4): -2.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 82 Å2
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 76.9±5.0 dyne/cm
Molar Volume: 120.3±5.0 cm3

Click to predict properties on the Chemicalize site


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